Schleyer, Paul von Ragué and Maslak, Przemyslaw and Chandrasekhar, Jayaraman and Grev, Roger S (1993) Is a CImage C quadruple bond possible? In: Tetrahedron Letters, 34 (40). pp. 6387-6390.
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Official URL: http://dx.doi.org/10.1016/0040-4039(93)85052-X
Abstract
Ab initio computations Predict a minimum for a carbon-carbon quadruple bond in C2. While the computed C-C separation, 1.128 angstrom, fits Pauling's bond order-bond length relationship well, this result is an artifact of the restricted Hartree Fock theory.
| Item Type: | Journal Article |
|---|---|
| Publication: | Tetrahedron Letters |
| Publisher: | Elsevier Science |
| Additional Information: | Copyright of this article belongs to Elsevier Science. |
| Department/Centre: | Division of Chemical Sciences > Organic Chemistry |
| Date Deposited: | 11 Feb 2011 06:31 |
| Last Modified: | 11 Feb 2011 06:31 |
| URI: | http://eprints.iisc.ac.in/id/eprint/35519 |
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